Glycoside
GD037721
Name:
(2s)-3-(alpha-d-galactopyranosyloxy)-2-[(9z)-octadec-9-enoyloxy]propyl (9z,12z)-octadeca-9,12-dienoateFormula:
C45H80O10Smiles:
CCCCCC=CCC=CCCCCCCCC(=O)OC[C@@H](CO[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@@H]1O)OC(=O)CCCCCCCC=CCCCCCCCCAglycone:
CCCCCC=CCC=CCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCC=CCCCCCCCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.82 |
| AlogP: | 9.11 | Num_rotatable_bonds: | 36 |
| MolWt: | 781.12 | Num_heavy_atoms: | 55 |
| TPSA: | 151.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD23711
Formula: C39H70O5
Smiles:
CCCCCC=CCC=CCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCC=CCCCCCCCC| HBA: | 5 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.79 |
| AlogP: | 11.28 | Num_rotatable_bonds: | 33 |
| MolWt: | 618.98 | Num_heavy_atoms: | 44 |
| TPSA: | 72.83 | NumAromaticRings: | 0 |
